SCHEMBL9502648

SCHEMBL9502648

C=Cc1ccc(C(=C)c2ccc(C)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
MAPT P10636 4/20 0.42
HTT P42858 3/20 0.41
GFER P55789 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
TDP1 Q9NUW8 4/20 0.40
NPSR1 Q6W5P4 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
PKM P14618 2/20 0.40
ATM Q13315 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
NLRP1 Q9C000 1/20 0.40
MEN1 O00255 1/20 0.40
NTSR1 P30989 1/20 0.40
KMT2A Q03164 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL123485 0.84 ALDH1A1 (0.55) ALDH1A1CYP3A4CYP2C9CYP2C19MAPT
SCHEMBL679555 0.83 ALDH1A1 (0.69) ALDH1A1CYP3A4CYP2C9CYP2C19MAPT
SCHEMBL14911 0.83
SCHEMBL893597 0.83 HTT (0.55) ALDH1A1MAPTHTTGFERHSD17B10
SCHEMBL4412916 0.83 HTT (0.55) ALDH1A1MAPTHTTGFERHSD17B10
Ethane SCHEMBL23051531 0.81 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19MAPT
Ammonia Solution, Strong SCHEMBL9397572 0.81 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19MAPT
Hydrochloric Acid SCHEMBL9861453 0.81 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19MAPT
Ethylene SCHEMBL10713150 0.81 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19MAPT
Charcoal, Activated SCHEMBL9462746 0.81 ALDH1A1 (0.65) ALDH1A1CYP3A4CYP2C9CYP2C19MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0279463-B1 GRAFT POLYMERIZATION OF SUBSTITUTED STYRENE POLYMERS HAVING PENDANT VINYLIDENE GROUPS Nippon Paint Co., Ltd. (JP) 1993-05-26 EP disclosed
EP-0311689-B1 PROCESS FOR SELECTIVELY MONOHYDROFORMYLATING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-06-10 EP disclosed
EP-0304495-B1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-05-27 EP disclosed
US-4982007-A CARBONYLATION CATALYST NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-01-01 US disclosed
US-4908473-A Reacting a (1-arylethenyl)vinylbenzene with carbon monoxide and water or alcohol in the presence of carbonylation catalyst NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-03-13 US disclosed
US-4853436-A Graft polymerization of substituted styrene polymers having pendant vinylidene groups NIPPON PAINT CO., LTD. (JP) 1989-08-01 US disclosed
EP-0311689-A1 PROCESS FOR SELECTIVELY MONOHYDROFORMYLATING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-04-19 EP disclosed
EP-0304495-A1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-03-01 EP disclosed
EP-0279463-A2 Graft polymerization of substituted styrene polymers having pendant vinylidene groups Nippon Paint Co., Ltd. (JP) 1988-08-24 EP disclosed